Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 2/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.48 |
| ▸ | CES2 | O00748 | 1/20 | 0.44 |
| ▸ | TACR1 | P25103 | 8/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.44 |
| ▸ | APEX1 | P27695 | 1/20 | 0.44 |
| ▸ | THPO | P40225 | 1/20 | 0.44 |
| ▸ | BLM | P54132 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL27799870 | 0.91 | IDO1 (0.44) | IDO1ALDH1A1TACR1MAPTCYP3A4 | |
| SCHEMBL14255479 | 0.90 | FFAR4 (0.44) | IDO1ALDH1A1TACR1MAPTCYP3A4 | |
| SCHEMBL27734414 | 0.89 | IDO1 (0.46) | IDO1ALDH1A1TACR1MAPTCYP3A4 | |
| SCHEMBL27734452 | 0.83 | P2RX1 (0.42) | IDO1ALDH1A1MAPTMEN1LMNA | |
| SCHEMBL28778785 | 0.83 | MRGPRX4 (0.38) | IDO1ALDH1A1TACR1MAPTCYP3A4 | |
| SCHEMBL13292600 | 0.83 | IDO1 (0.47) | IDO1ALDH1A1CES2TACR1MAPT | |
| SCHEMBL2660451 | 0.83 | PRKCA (0.63) | IDO1ALDH1A1MAPTPRKCAPRKCD | |
| SCHEMBL27800047 | 0.82 | ALDH1A1 (0.41) | IDO1ALDH1A1TACR1MAPTCYP3A4 | |
| SCHEMBL8838335 | 0.82 | IDO1 (0.50) | IDO1ALDH1A1CES2TACR1MAPT | |
| SCHEMBL5663864 | 0.82 | TACR1 (0.42) | IDO1CES2TACR1CYP1A2CYP2C19 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7345040-B2 | Reverse-turn mimetics and compositions and methods relating thereto | MYRIAD GENETICS, INC. (US) | 2008-03-18 | — | — | US | disclosed |
| US-5696267-A | ANTIHISTAMINES; ANTIINFLAMMATORY AGENTS; GASTROINTESTINAL DISORDERS | SCHERING CORPORATION (US) | 1997-12-09 | — | — | US | disclosed |